SCHEMBL7250372

SCHEMBL7250372

C/C=C/C(=O)OCC=CC(=O)OC(=O)/C=C/C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.36
MAPT P10636 2/20 0.35
HCAR2 Q8TDS4 2/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
RAB9A P51151 1/20 0.31
TTR P02766 1/20 0.31
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28725778 0.87 GSTP1 (0.40) GSTP1MAPTHCAR2ATMALDH1A1
SCHEMBL11054119 0.85 GSTP1 (0.39) GSTP1MAPTHCAR2ATMALDH1A1
SCHEMBL13220390 0.83 AKT1 (0.42) HCAR2
SCHEMBL656055 0.81 GSTP1 (0.37) GSTP1MAPTHCAR2ATMCACNA1B
SCHEMBL13244979 0.80 MAPT (0.34) GSTP1MAPTHCAR2ATMALDH1A1
SCHEMBL12785471 0.79 GSTP1 (0.36) GSTP1MAPTHCAR2ATMCACNA1B
SCHEMBL7746005 0.79 MAPT (0.39) MAPTHCAR2ATMALDH1A1CACNA1B
SCHEMBL25405174 0.79 HCAR2 (0.40) GSTP1HCAR2ALDH1A1
SCHEMBL16505 0.79 HCAR2 (0.40) GSTP1HCAR2ALDH1A1
SCHEMBL25405178 0.79 HCAR2 (0.40) GSTP1HCAR2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030129428-A1 MULTILAYER POLYAMIDE FILM STRUCTURES WILMINGTON TRUST COMPANY 2003-07-10 US claimed
EP-0904198-A1 MULTILAYER POLYAMIDE FILM STRUCTURES AlliedSignal Inc. (US) 1999-03-31 EP claimed
WO-1997047468-A1 MULTILAYER POLYAMIDE FILM STRUCTURES ALLIEDSIGNAL INC. (US) 1997-12-18 WO claimed
WO-1997028165-A1 DERIVATIVES OF CAMPTOTHECIN FOR USE IN TREATING CANCER THE STEHLIN FOUNDATION FOR CANCER RESEARCH (US) 1997-08-07 WO disclosed